REMARK  Name = BDB059668
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.221  -1.206   0.145  0.00  0.00    +0.049 A 
ATOM      2  C   LIG    1        0.532  -2.499   0.383  0.00  0.00    +0.279 A 
ATOM      3  O   LIG    1       -0.004  -3.579   0.599  0.00  0.00    -0.265 OA
ATOM      4  N   LIG    1        1.932  -2.388   0.350  0.00  0.00    -0.179 N 
ATOM      5  C   LIG    1        2.623  -1.212   0.141  0.00  0.00    +0.156 A 
ATOM      6  C   LIG    1        3.958  -1.526   0.188  0.00  0.00    +0.114 A 
ATOM      7  C   LIG    1        3.992  -2.910   0.431  0.00  0.00    +0.156 A 
ATOM      8  N   LIG    1        1.908  -0.083  -0.049  0.00  0.00    -0.338 N 
ATOM      9  H   LIG    1        2.347   0.830  -0.189  0.00  0.00    +0.167 HD
ATOM     10  N   LIG    1        2.772  -3.446   0.533  0.00  0.00    -0.169 NA
ATOM     11  C   LIG    1        0.520  -0.084  -0.043  0.00  0.00    +0.057 A 
ENDROOT
BRANCH  11  12
ATOM     12  C   LIG    1       -0.068   1.255  -0.241  0.00  0.00    -0.001 A 
ATOM     13  C   LIG    1       -0.472   2.024   0.858  0.00  0.00    +0.010 A 
ATOM     14  C   LIG    1       -0.989   3.307   0.667  0.00  0.00    +0.001 A 
ATOM     15  C   LIG    1       -1.093   3.833  -0.619  0.00  0.00    +0.000 A 
ATOM     16  C   LIG    1       -0.677   3.082  -1.717  0.00  0.00    +0.001 A 
ATOM     17  C   LIG    1       -0.160   1.799  -1.530  0.00  0.00    +0.010 A 
ENDBRANCH  11  12
BRANCH   1  18
ATOM     18  C   LIG    1       -1.738  -1.380   0.162  0.00  0.00    +0.045 C 
ATOM     19  C   LIG    1       -2.289  -1.135   1.573  0.00  0.00    +0.017 C 
BRANCH  18  21
ATOM     20  C   LIG    1       -3.429   0.266  -0.842  0.00  0.00    +0.004 C 
ATOM     21  C   LIG    1       -2.450  -0.643  -0.956  0.00  0.00    -0.026 C 
ENDBRANCH  18  21
ENDBRANCH   1  18
BRANCH   6  22
ATOM     22  C   LIG    1        5.059  -0.641   0.026  0.00  0.00    +0.104 C 
ATOM     23  N   LIG    1        5.951   0.088  -0.107  0.00  0.00    -0.191 NA
ENDBRANCH   6  22
TORSDOF 4